4-amino-5-phenylmethoxyoxolan-2-ol

C11H15NO3 — CID 163839352

IUPAC4-amino-5-phenylmethoxyoxolan-2-ol
SMILESNC1CC(O)OC1OCc1ccccc1
InChIInChI=1S/C11H15NO3/c12-9-6-10(13)15-11(9)14-7-8-4-2-1-3-5-8/h1-5,9-11,13H,6-7,12H2
InChIKeyOKNZRJHXSAGAPU-UHFFFAOYSA-N
MW209.25 g/mol
LogP0.60
Rot. Bonds3

About 4-amino-5-phenylmethoxyoxolan-2-ol

4-amino-5-phenylmethoxyoxolan-2-ol (PubChem CID 163839352) has the molecular formula C11H15NO3 and a molecular weight of 209.25 g/mol. Its IUPAC name is 4-amino-5-phenylmethoxyoxolan-2-ol.

Molecular Properties

Compound Name4-amino-5-phenylmethoxyoxolan-2-ol
PubChem CID163839352
Molecular FormulaC11H15NO3
Molecular Weight209.25 g/mol
Exact Mass209.11
IUPAC Name4-amino-5-phenylmethoxyoxolan-2-ol
SMILESNC1CC(O)OC1OCc1ccccc1
InChIInChI=1S/C11H15NO3/c12-9-6-10(13)15-11(9)14-7-8-4-2-1-3-5-8/h1-5,9-11,13H,6-7,12H2
InChIKeyOKNZRJHXSAGAPU-UHFFFAOYSA-N
XLogP0.60
TPSA64.71 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.25
LogP ≤ 50.60
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

[(2S,3S,5R,6S)-3,5-diamino-6-phenylmethoxyoxan-2-yl]methanol
CID 131227318
(2S,3S,4R,5S)-3,4,5-tris(phenylmethoxy)oxolan-2-ol
CID 97267896
(1S,2S,3S,4R,5R)-5-amino-2,3,4-tris(phenylmethoxy)cyclohexan-1-ol
CID 15460032
(1S,5R,6S,8S)-9-phenylmethoxy-2,4,10-trioxatricyclo[3.3.1.13,7]decane-6,8-diol
CID 101371356
(6S)-4-phenylmethoxy-6-(phenylmethoxymethyl)oxan-2-ol
CID 146358765
(5S)-6-methyl-4,5-bis(phenylmethoxy)oxan-2-ol
CID 126612131
(2R,3S,4R,5S)-2-phenylmethoxyoxane-3,4,5-triol
CID 11564962
(2R,3R,4S,5S)-2-phenylmethoxyoxane-3,4,5-triol
CID 11253449
(3R,6S)-5-amino-2-(hydroxymethyl)-6-phenylmethoxyoxane-3,4-diol
CID 131700365
(2S,3S,4S,5R,6S)-4-amino-2-(hydroxymethyl)-6-phenylmethoxyoxane-3,5-diol
CID 93088189
(2S,3S,5R,6R)-4-phenylmethoxyoxane-2,3,5,6-tetrol
CID 131023997
(2R,3S,4S,5R,6R)-2-methyl-3,5,6-tris(phenylmethoxy)oxan-4-ol
CID 11080578

Frequently Asked Questions

What is the IUPAC name of 4-amino-5-phenylmethoxyoxolan-2-ol?
The IUPAC name of 4-amino-5-phenylmethoxyoxolan-2-ol (CID 163839352) is 4-amino-5-phenylmethoxyoxolan-2-ol.
What is the SMILES notation for 4-amino-5-phenylmethoxyoxolan-2-ol?
The canonical SMILES for 4-amino-5-phenylmethoxyoxolan-2-ol is NC1CC(O)OC1OCc1ccccc1.
What is the InChIKey of 4-amino-5-phenylmethoxyoxolan-2-ol?
The InChIKey is OKNZRJHXSAGAPU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15NO3/c12-9-6-10(13)15-11(9)14-7-8-4-2-1-3-5-8/h1-5,9-11,13H,6-7,12H2.
What are the key properties of 4-amino-5-phenylmethoxyoxolan-2-ol?
4-amino-5-phenylmethoxyoxolan-2-ol has a molecular weight of 209.25 g/mol, XLogP of 0.60, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-5-phenylmethoxyoxolan-2-ol is sourced from PubChem (CID 163839352), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).